CID 6445838

4-(3-butoxy-1-propenyl)-n,n-dimethylbenzenamine hydrochloride

Structural Information

Molecular Formula
C15H23NO
SMILES
CCCCOC/C=C/C1=CC=C(C=C1)N(C)C
InChI
InChI=1S/C15H23NO/c1-4-5-12-17-13-6-7-14-8-10-15(11-9-14)16(2)3/h6-11H,4-5,12-13H2,1-3H3/b7-6+
InChIKey
IESQLPGXNJEOOD-VOTSOKGWSA-N
Compound name
4-[(E)-3-butoxyprop-1-enyl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.17796 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.18524 157.6
[M+Na]+ 256.16718 163.0
[M-H]- 232.17068 161.9
[M+NH4]+ 251.21178 176.1
[M+K]+ 272.14112 160.9
[M+H-H2O]+ 216.17522 150.4
[M+HCOO]- 278.17616 182.1
[M+CH3COO]- 292.19181 199.4
[M+Na-2H]- 254.15263 161.4
[M]+ 233.17741 161.3
[M]- 233.17851 161.3
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.