CID 58126

Brn 3125405

Structural Information

Molecular Formula
C14H27N
SMILES
CCCCNC1(C2CCC(C2)C1(C)C)C
InChI
InChI=1S/C14H27N/c1-5-6-9-15-14(4)12-8-7-11(10-12)13(14,2)3/h11-12,15H,5-10H2,1-4H3
InChIKey
YETIEFAHKKAEOY-UHFFFAOYSA-N
Compound name
N-butyl-2,3,3-trimethylbicyclo[2.2.1]heptan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.21436 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.22164 152.4
[M+Na]+ 232.20358 159.2
[M-H]- 208.20708 155.0
[M+NH4]+ 227.24818 180.5
[M+K]+ 248.17752 155.8
[M+H-H2O]+ 192.21162 148.8
[M+HCOO]- 254.21256 172.9
[M+CH3COO]- 268.22821 192.9
[M+Na-2H]- 230.18903 155.6
[M]+ 209.21381 152.4
[M]- 209.21491 152.4
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.