CID 2794226

N-isopropylhexadecylamine

Structural Information

Molecular Formula
C19H41N
SMILES
CCCCCCCCCCCCCCCCNC(C)C
InChI
InChI=1S/C19H41N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19(2)3/h19-20H,4-18H2,1-3H3
InChIKey
KRVYVVWZAYMURR-UHFFFAOYSA-N
Compound name
N-propan-2-ylhexadecan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

283.3239 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.33118 182.8
[M+Na]+ 306.31312 183.5
[M-H]- 282.31662 180.6
[M+NH4]+ 301.35772 198.6
[M+K]+ 322.28706 180.2
[M+H-H2O]+ 266.32116 175.6
[M+HCOO]- 328.32210 202.2
[M+CH3COO]- 342.33775 212.1
[M+Na-2H]- 304.29857 181.8
[M]+ 283.32335 187.5
[M]- 283.32445 187.5
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

patents stripe