CID 16775041

[(furan-2-yl)methyl](3-methylbutyl)amine hydrochloride

Structural Information

Molecular Formula
C10H17NO
SMILES
CC(C)CCNCC1=CC=CO1
InChI
InChI=1S/C10H17NO/c1-9(2)5-6-11-8-10-4-3-7-12-10/h3-4,7,9,11H,5-6,8H2,1-2H3
InChIKey
SALRNWVFVBHCQW-UHFFFAOYSA-N
Compound name
N-(furan-2-ylmethyl)-3-methylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

167.13101 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.13829 139.7
[M+Na]+ 190.12023 145.4
[M-H]- 166.12373 143.5
[M+NH4]+ 185.16483 160.3
[M+K]+ 206.09417 145.3
[M+H-H2O]+ 150.12827 133.7
[M+HCOO]- 212.12921 163.9
[M+CH3COO]- 226.14486 182.0
[M+Na-2H]- 188.10568 145.0
[M]+ 167.13046 141.2
[M]- 167.13156 141.2
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

patents stripe