CID 40761

1-aminotridecane

Structural Information

Molecular Formula
C13H29N
SMILES
CCCCCCCCCCCCCN
InChI
InChI=1S/C13H29N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h2-14H2,1H3
InChIKey
ABVVEAHYODGCLZ-UHFFFAOYSA-N
Compound name
tridecan-1-amine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

5
References

21476
Patents

199.23 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.23728 155.1
[M+Na]+ 222.21922 158.5
[M-H]- 198.22272 153.4
[M+NH4]+ 217.26382 174.1
[M+K]+ 238.19316 156.1
[M+H-H2O]+ 182.22726 149.0
[M+HCOO]- 244.22820 176.9
[M+CH3COO]- 258.24385 192.6
[M+Na-2H]- 220.20467 157.5
[M]+ 199.22945 157.2
[M]- 199.23055 157.2
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.