CID 38133

N,n,5-trimethyl-2-furanethylamine hydrochloride

Structural Information

Molecular Formula
C9H15NO
SMILES
CC1=CC=C(O1)CCN(C)C
InChI
InChI=1S/C9H15NO/c1-8-4-5-9(11-8)6-7-10(2)3/h4-5H,6-7H2,1-3H3
InChIKey
ZYIGSCQQWBJPKA-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(5-methylfuran-2-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.11537 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.12265 133.8
[M+Na]+ 176.10459 141.4
[M-H]- 152.10809 139.6
[M+NH4]+ 171.14919 156.1
[M+K]+ 192.07853 142.4
[M+H-H2O]+ 136.11263 128.2
[M+HCOO]- 198.11357 159.8
[M+CH3COO]- 212.12922 182.8
[M+Na-2H]- 174.09004 139.5
[M]+ 153.11482 137.3
[M]- 153.11592 137.3
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.