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]+ 193.16992 145.5
[M+Na]+ 215.15186 156.6
[M-H]- 191.15536 148.7
[M+NH4]+ 210.19646 171.5
[M+K]+ 231.12580 149.6
[M+H-H2O]+ 175.15990 135.6
[M+HCOO]- 237.16084 163.7
[M+CH3COO]- 251.17649 199.6
[M+Na-2H]- 213.13731 150.0
[M]+ 192.16209 140.3
[M]- 192.16319 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.