CID 202798

N-methyl-n-2-propynyl-2-norbornanemethylamine

Structural Information

Molecular Formula
C12H19N
SMILES
CN(CC#C)CC1CC2CCC1C2
InChI
InChI=1S/C12H19N/c1-3-6-13(2)9-12-8-10-4-5-11(12)7-10/h1,10-12H,4-9H2,2H3
InChIKey
BEAHFQLGTDUFOP-UHFFFAOYSA-N
Compound name
N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylprop-2-yn-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.15175 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.15903 145.7
[M+Na]+ 200.14097 154.4
[M-H]- 176.14447 148.0
[M+NH4]+ 195.18557 168.6
[M+K]+ 216.11491 148.9
[M+H-H2O]+ 160.14901 134.5
[M+HCOO]- 222.14995 162.1
[M+CH3COO]- 236.16560 195.8
[M+Na-2H]- 198.12642 146.9
[M]+ 177.15120 139.7
[M]- 177.15230 139.7
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.