CID 5356789

Oleylamine

Structural Information

Molecular Formula
C18H37N
SMILES
CCCCCCCC/C=C\CCCCCCCCN
InChI
InChI=1S/C18H37N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h9-10H,2-8,11-19H2,1H3/b10-9-
InChIKey
QGLWBTPVKHMVHM-KTKRTIGZSA-N
Compound name
(Z)-octadec-9-en-1-amine
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

317
References

73016
Patents

267.2926 Da
Monoisotopic Mass

7.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.299876 176.0
[M+Na]+ 290.281818 177.7
[M-H]- 266.285324 173.4
[M+NH4]+ 285.326423 192.2
[M+K]+ 306.255758 173.3
[M+H-H2O]+ 250.289860 169.0
[M+HCOO]- 312.290801 196.4
[M+CH3COO]- 326.306451 206.2
[M+Na-2H]- 288.267266 175.8
[M]+ 267.29205142 179.2
[M]- 267.29314858 179.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe