CID 32528

(+-)-endo-(2-bornylamino)acetonitrile hydrochloride

Structural Information

Molecular Formula
C12H20N2
SMILES
CC1(C2CCC1(C(C2)NCC#N)C)C
InChI
InChI=1S/C12H20N2/c1-11(2)9-4-5-12(11,3)10(8-9)14-7-6-13/h9-10,14H,4-5,7-8H2,1-3H3
InChIKey
RKMKYSJVHGTOET-UHFFFAOYSA-N
Compound name
2-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)amino]acetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.16264 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.169916 145.5
[M+Na]+ 215.151858 156.6
[M-H]- 191.155364 148.7
[M+NH4]+ 210.196463 171.5
[M+K]+ 231.125798 149.6
[M+H-H2O]+ 175.159900 135.6
[M+HCOO]- 237.160841 163.7
[M+CH3COO]- 251.176491 199.6
[M+Na-2H]- 213.137306 150.0
[M]+ 192.16209142 140.3
[M]- 192.16318858 140.3
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.