CID 32530

(+-)-endo-n-2-bornylglycine tert-butyl ester hydrochloride

Structural Information

Molecular Formula
C16H29NO2
SMILES
CC1(C2CCC1(C(C2)NCC(=O)OC(C)(C)C)C)C
InChI
InChI=1S/C16H29NO2/c1-14(2,3)19-13(18)10-17-12-9-11-7-8-16(12,6)15(11,4)5/h11-12,17H,7-10H2,1-6H3
InChIKey
TURYMEWBTSRVPL-UHFFFAOYSA-N
Compound name
tert-butyl 2-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.21982 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.227096 167.3
[M+Na]+ 290.209038 173.5
[M-H]- 266.212544 169.9
[M+NH4]+ 285.253643 193.1
[M+K]+ 306.182978 171.4
[M+H-H2O]+ 250.217080 164.9
[M+HCOO]- 312.218021 185.1
[M+CH3COO]- 326.233671 201.8
[M+Na-2H]- 288.194486 170.1
[M]+ 267.21927142 169.1
[M]- 267.22036858 169.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.